Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6w53_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 5.A N ILE 2.A O no hydrogen 3.228 N/A ARG 6.A NH1 THR 67.A OG1 no hydrogen 2.848 N/A TYR 7.A N ASP 5.A OD1 no hydrogen 2.992 N/A ASN 9.A N ASP 5.A O no hydrogen 2.895 N/A ASN 9.A ND2 THR 65.A O no hydrogen 2.984 N/A GLY 11.A N ASN 9.A OD1 no hydrogen 2.962 N/A THR 12.A OG1 GLU 33.A OE1 no hydrogen 2.445 N/A ALA 13.A N ARG 10.A O no hydrogen 3.011 N/A PHE 14.A N GLY 11.A O no hydrogen 3.085 N/A THR 15.A N GLU 18.A OE1 no hydrogen 2.902 N/A THR 15.A OG1 GLU 17.A OE2 no hydrogen 3.410 N/A GLU 17.A N GLU 17.A OE2 no hydrogen 2.789 N/A GLU 18.A N THR 15.A OG1 no hydrogen 3.015 N/A ARG 19.A N THR 15.A O no hydrogen 2.831 N/A ARG 19.A NE PHE 14.A O no hydrogen 2.891 N/A ARG 19.A NH1 PRO 29.A O no hydrogen 2.832 N/A ARG 19.A NH2 THR 12.A O no hydrogen 3.020 N/A ARG 19.A NH2 PHE 14.A O no hydrogen 3.046 N/A ARG 19.A NH2 VAL 31.A O no hydrogen 3.060 N/A GLN 20.A N MET 16.A O no hydrogen 2.976 N/A LYS 21.A N GLU 17.A O no hydrogen 3.004 N/A LEU 22.A N GLU 18.A O no hydrogen 2.724 N/A HIS 23.A N GLN 20.A O no hydrogen 3.045 N/A ILE 24.A N ARG 19.A O no hydrogen 2.791 N/A LEU 25.A N ARG 19.A O no hydrogen 3.163 N/A ARG 27.A N ILE 24.A O no hydrogen 2.973 N/A GLU 33.A N THR 12.A O no hydrogen 3.051 N/A THR 34.A N GLU 37.A OE1 no hydrogen 2.857 N/A THR 34.A OG1 GLU 37.A OE1 no hydrogen 3.476 N/A GLU 36.A N GLU 36.A OE1 no hydrogen 2.960 N/A GLU 37.A N THR 34.A OG1 no hydrogen 3.269 N/A GLN 38.A N THR 34.A O no hydrogen 3.046 N/A GLN 38.A NE2 ARG 10.A O no hydrogen 2.870 N/A GLN 38.A NE2 THR 12.A OG1 no hydrogen 3.256 N/A VAL 39.A N LEU 35.A O no hydrogen 2.849 N/A ALA 40.A N GLU 36.A O no hydrogen 3.163 N/A ARG 41.A N GLU 37.A O no hydrogen 3.066 N/A ARG 41.A NE GLU 33.A OE1 no hydrogen 3.233 N/A ARG 41.A NE GLU 33.A OE2 no hydrogen 2.946 N/A ARG 41.A NH1 GLN 45.A OE1 no hydrogen 3.311 N/A ARG 41.A NH2 THR 12.A OG1 no hydrogen 3.387 N/A ARG 41.A NH2 GLU 33.A OE1 no hydrogen 2.756 N/A VAL 42.A N GLN 38.A O no hydrogen 2.834 N/A TYR 43.A N VAL 39.A O no hydrogen 2.824 N/A TYR 43.A OH GLU 80.A OE1 no hydrogen 2.557 N/A TYR 43.A OH GLU 80.A OE2 no hydrogen 3.306 N/A GLY 44.A N ALA 40.A O no hydrogen 3.141 N/A GLN 45.A N ARG 41.A O no hydrogen 2.933 N/A GLN 45.A NE2 HIS 58.A NE2 no hydrogen 2.936 N/A VAL 46.A N VAL 42.A O no hydrogen 2.880 N/A LYS 47.A N TYR 43.A O no hydrogen 3.177 N/A LYS 47.A NZ TYR 43.A OH no hydrogen 3.327 N/A LYS 47.A NZ GLU 80.A OE2 no hydrogen 2.645 N/A LYS 48.A N GLY 44.A O no hydrogen 3.144 N/A LYS 48.A N GLN 45.A O no hydrogen 3.131 N/A TYR 49.A N VAL 46.A O no hydrogen 2.949 N/A ARG 55.A N LYS 51.A O no hydrogen 3.030 N/A ARG 55.A NE TYR 49.A O no hydrogen 2.652 N/A ARG 55.A NH2 TYR 49.A O no hydrogen 3.021 N/A TYR 56.A N PRO 52.A O no hydrogen 2.855 N/A GLN 57.A N ILE 53.A O no hydrogen 2.953 N/A HIS 58.A N ASN 54.A O no hydrogen 3.045 N/A LEU 59.A N ARG 55.A O no hydrogen 3.025 N/A VAL 60.A N TYR 56.A O no hydrogen 2.857 N/A SER 61.A N GLN 57.A O no hydrogen 3.323 N/A VAL 62.A N HIS 58.A O no hydrogen 3.024 N/A HIS 63.A N LEU 59.A O no hydrogen 2.933 N/A SER 64.A N VAL 60.A O no hydrogen 3.015 N/A THR 65.A N SER 61.A O no hydrogen 3.220 N/A THR 65.A N VAL 62.A O no hydrogen 3.024 N/A THR 65.A OG1 SER 61.A O no hydrogen 2.960 N/A ASN 66.A N VAL 62.A O no hydrogen 2.895 N/A ASN 66.A ND2 TYR 538.A OH no hydrogen 2.980 N/A THR 67.A N ARG 6.A O no hydrogen 2.857 N/A THR 67.A OG1 HIS 63.A O no hydrogen 2.721 N/A LEU 69.A N ASN 66.A OD1 no hydrogen 3.105 N/A TYR 70.A N ASN 66.A O no hydrogen 3.118 N/A TYR 71.A N THR 67.A O no hydrogen 3.223 N/A TYR 71.A OH SER 155.A OG no hydrogen 2.906 N/A ALA 72.A N THR 68.A O no hydrogen 2.957 N/A THR 73.A N LEU 69.A O no hydrogen 3.006 N/A THR 73.A OG1 LEU 69.A O no hydrogen 2.690 N/A ILE 74.A N TYR 70.A O no hydrogen 3.177 N/A LEU 75.A N TYR 71.A O no hydrogen 2.988 N/A ALA 76.A N ALA 72.A O no hydrogen 3.163 N/A HIS 77.A N ILE 74.A O no hydrogen 3.057 N/A MET 81.A N HIS 77.A O no hydrogen 2.855 N/A LEU 82.A N LEU 78.A O no hydrogen 2.873 N/A ILE 84.A N MET 81.A O no hydrogen 2.922 N/A ILE 85.A N MET 81.A O no hydrogen 2.992 N/A TYR 86.A N LEU 82.A O no hydrogen 3.059 N/A TYR 86.A OH GLU 224.A OE2 no hydrogen 2.642 N/A THR 89.A N PRO 83.A O no hydrogen 3.227 N/A THR 89.A OG1 PRO 83.A O no hydrogen 2.542 N/A VAL 90.A N TYR 86.A O no hydrogen 3.140 N/A ALA 93.A N THR 89.A O no hydrogen 2.862 N/A CYS 94.A N VAL 90.A O no hydrogen 2.828 N/A CYS 94.A SG VAL 90.A O no hydrogen 3.283 N/A CYS 94.A SG ASN 145.A O no hydrogen 3.129 N/A MET 95.A N GLY 91.A O no hydrogen 2.819 N/A GLU 96.A N GLU 92.A O no hydrogen 3.077 N/A TYR 97.A N ALA 93.A O no hydrogen 2.668 N/A LEU 100.A N TYR 97.A O no hydrogen 2.909 N/A PHE 101.A N SER 98.A O no hydrogen 3.102 N/A PHE 102.A N HIS 99.A O no hydrogen 3.236 N/A GLU 104.A N PHE 101.A O no hydrogen 3.210 N/A ARG 105.A NH2 ALA 124.A O no hydrogen 3.168 N/A ARG 105.A NH2 GLY 125.A O no hydrogen 3.222 N/A VAL 107.A N PRO 170.A O no hydrogen 2.966 N/A PHE 109.A N ILE 172.A O no hydrogen 2.826 N/A ARG 111.A NE GLU 193.A OE1 no hydrogen 3.103 N/A ARG 111.A NE GLU 193.A OE2 no hydrogen 3.437 N/A ARG 111.A NH2 GLU 193.A OE1 no hydrogen 2.949 N/A LEU 112.A N ASN 110.A OD1 no hydrogen 2.892 N/A TYR 113.A N ASN 110.A O no hydrogen 3.134 N/A LYS 114.A N ARG 111.A O no hydrogen 3.039 N/A GLY 115.A N GLU 207.A OE1 no hydrogen 2.829 N/A GLN 116.A N TYR 113.A O no hydrogen 2.788 N/A PHE 117.A N GLU 207.A OE2 no hydrogen 2.907 N/A ARG 118.A NE GLU 215.A OE2 no hydrogen 2.807 N/A ARG 118.A NH2 GLU 215.A OE2 no hydrogen 2.561 N/A ILE 120.A N GLN 116.A O no hydrogen 3.138 N/A MET 121.A N PHE 117.A O no hydrogen 3.054 N/A ARG 122.A N ARG 118.A O no hydrogen 2.906 N/A ASP 123.A N ASN 119.A O no hydrogen 2.985 N/A ALA 124.A N ILE 120.A O no hydrogen 3.111 N/A ALA 124.A N MET 121.A O no hydrogen 3.150 N/A GLY 125.A N ARG 122.A O no hydrogen 3.009 N/A GLU 130.A N LEU 167.A O no hydrogen 2.928 N/A VAL 131.A N LEU 167.A O no hydrogen 3.432 N/A VAL 132.A N VAL 220.A O no hydrogen 2.851 N/A VAL 133.A N VAL 169.A O no hydrogen 3.146 N/A ILE 134.A N GLN 222.A O no hydrogen 3.038 N/A THR 135.A N VAL 171.A O no hydrogen 3.300 N/A THR 135.A OG1 GLU 224.A O no hydrogen 2.612 N/A THR 135.A OG1 ASP 225.A O no hydrogen 3.529 N/A GLY 137.A N THR 135.A OG1 no hydrogen 3.173 N/A SER 138.A N ASP 136.A OD1 no hydrogen 2.864 N/A SER 138.A OG ASP 136.A OD1 no hydrogen 2.419 N/A SER 138.A OG ASP 136.A OD2 no hydrogen 3.423 N/A SER 138.A OG SER 227.A OG no hydrogen 3.088 N/A LEU 142.A N GLY 137.A O no hydrogen 2.888 N/A GLY 143.A N ASP 141.A OD1 no hydrogen 2.909 N/A SER 144.A N TYR 188.A OH no hydrogen 2.916 N/A ASN 145.A N LEU 142.A O no hydrogen 2.932 N/A ASN 145.A ND2 CYS 94.A O no hydrogen 3.183 N/A ASN 145.A ND2 TYR 182.A OH no hydrogen 3.011 N/A GLY 146.A N GLY 143.A O no hydrogen 2.929 N/A ILE 147.A N SER 144.A O no hydrogen 3.149 N/A GLY 148.A N ASN 145.A O no hydrogen 3.186 N/A SER 150.A N GLY 146.A O no hydrogen 3.335 N/A SER 150.A OG VAL 133.A O no hydrogen 3.309 N/A SER 150.A OG VAL 171.A O no hydrogen 2.806 N/A ILE 151.A N ILE 147.A O no hydrogen 2.905 N/A GLY 152.A N GLY 148.A O no hydrogen 2.866 N/A LYS 153.A N ILE 149.A O no hydrogen 3.012 N/A LYS 153.A NZ GLU 224.A OE1 no hydrogen 3.041 N/A LYS 153.A NZ GLU 224.A OE2 no hydrogen 2.938 N/A LYS 153.A NZ ASP 247.A OD2 no hydrogen 2.834 N/A CYS 154.A N SER 150.A O no hydrogen 2.876 N/A CYS 154.A SG SER 150.A O no hydrogen 3.313 N/A SER 155.A N ILE 151.A O no hydrogen 3.178 N/A SER 155.A OG TYR 71.A OH no hydrogen 2.906 N/A LEU 156.A N GLY 152.A O no hydrogen 3.341 N/A LEU 156.A N LYS 153.A O no hydrogen 3.021 N/A TYR 157.A N LYS 153.A O no hydrogen 3.278 N/A TYR 157.A OH GLN 222.A OE1 no hydrogen 2.704 N/A VAL 158.A N CYS 154.A O no hydrogen 3.211 N/A ALA 159.A N SER 155.A O no hydrogen 2.957 N/A GLY 160.A N LEU 156.A O no hydrogen 2.783 N/A ALA 161.A N TYR 157.A O no hydrogen 3.019 N/A GLY 162.A N VAL 158.A O no hydrogen 3.006 N/A ARG 166.A N ASP 164.A OD1 no hydrogen 2.868 N/A ARG 166.A NH1 ASP 164.A OD1 no hydrogen 2.944 N/A ARG 166.A NH1 ASP 164.A OD2 no hydrogen 3.193 N/A LEU 167.A N ASP 164.A O no hydrogen 2.832 N/A VAL 169.A N VAL 131.A O no hydrogen 2.982 N/A VAL 171.A N VAL 133.A O no hydrogen 2.863 N/A ILE 172.A N VAL 107.A O no hydrogen 3.017 N/A LEU 173.A N THR 135.A O no hydrogen 2.937 N/A ASP 174.A N PHE 109.A O no hydrogen 2.812 N/A GLY 176.A N ASP 174.A OD1 no hydrogen 2.925 N/A THR 177.A N GLU 193.A O no hydrogen 2.958 N/A THR 177.A OG1 ASP 141.A OD1 no hydrogen 2.805 N/A ASN 178.A N ASP 141.A OD2 no hydrogen 2.983 N/A ASN 179.A N THR 177.A OG1 no hydrogen 3.132 N/A ASN 179.A ND2 ASP 141.A O no hydrogen 2.831 N/A TYR 182.A N ASN 179.A OD1 no hydrogen 3.192 N/A TYR 182.A OH CYS 94.A O no hydrogen 3.400 N/A TYR 182.A OH MET 95.A O no hydrogen 2.611 N/A LEU 183.A N ASN 179.A O no hydrogen 3.014 N/A GLN 184.A N GLU 180.A O no hydrogen 3.224 N/A GLN 184.A N ARG 181.A O no hydrogen 3.222 N/A ASP 185.A N TYR 182.A O no hydrogen 2.820 N/A ASP 187.A N ASP 185.A OD1 no hydrogen 2.818 N/A TYR 188.A N ASP 185.A O no hydrogen 3.057 N/A MET 191.A N ASP 174.A OD2 no hydrogen 2.828 N/A ARG 192.A NH1 LEU 183.A O no hydrogen 2.876 N/A ARG 192.A NH1 ASP 185.A O no hydrogen 2.739 N/A ARG 192.A NH2 ASP 185.A O no hydrogen 2.799 N/A LYS 194.A NZ GLU 180.A OE2 no hydrogen 3.472 N/A ARG 195.A N ASN 178.A OD1 no hydrogen 3.097 N/A ARG 195.A NE ASP 141.A OD2 no hydrogen 2.745 N/A ARG 195.A NH1 ASP 136.A O no hydrogen 3.301 N/A ARG 195.A NH2 ASP 136.A O no hydrogen 2.936 N/A ARG 195.A NH2 ASP 141.A OD1 no hydrogen 2.886 N/A ARG 195.A NH2 ASP 141.A OD2 no hydrogen 3.493 N/A LEU 196.A N VAL 175.A O no hydrogen 2.967 N/A PHE 201.A N GLY 197.A O no hydrogen 2.918 N/A TYR 202.A N ASP 198.A O no hydrogen 2.914 N/A GLU 203.A N GLU 199.A O no hydrogen 3.026 N/A LEU 204.A N GLU 200.A O no hydrogen 3.059 N/A LEU 205.A N PHE 201.A O no hydrogen 2.924 N/A ASP 206.A N TYR 202.A O no hydrogen 2.706 N/A GLU 207.A N GLU 203.A O no hydrogen 3.143 N/A PHE 208.A N LEU 204.A O no hydrogen 2.936 N/A MET 209.A N LEU 205.A O no hydrogen 3.005 N/A GLU 210.A N ASP 206.A O no hydrogen 2.947 N/A ALA 211.A N GLU 207.A O no hydrogen 2.811 N/A ALA 212.A N PHE 208.A O no hydrogen 2.882 N/A SER 213.A N MET 209.A O no hydrogen 3.011 N/A SER 213.A OG MET 209.A O no hydrogen 3.554 N/A SER 213.A OG GLU 210.A O no hydrogen 3.061 N/A ALA 214.A N GLU 210.A O no hydrogen 3.257 N/A ALA 214.A N ALA 211.A O no hydrogen 3.121 N/A GLU 215.A N ALA 211.A O no hydrogen 2.838 N/A TRP 216.A N ALA 212.A O no hydrogen 2.769 N/A ALA 219.A N TRP 216.A O no hydrogen 3.105 N/A VAL 220.A N GLU 130.A O no hydrogen 2.773 N/A ILE 221.A N ARG 243.A O no hydrogen 2.818 N/A GLN 222.A N VAL 132.A O no hydrogen 2.766 N/A GLN 222.A NE2 PHE 223.A O no hydrogen 2.664 N/A GLN 222.A NE2 GLU 224.A OE1 no hydrogen 2.731 N/A PHE 223.A N PHE 245.A O no hydrogen 2.929 N/A GLU 224.A N ILE 134.A O no hydrogen 2.978 N/A ASP 225.A N ASP 248.A OD2 no hydrogen 2.821 N/A SER 227.A N SER 138.A OG no hydrogen 2.834 N/A SER 227.A OG SER 138.A OG no hydrogen 3.088 N/A SER 227.A OG ASN 229.A OD1 no hydrogen 2.562 N/A HIS 230.A N SER 227.A O no hydrogen 3.020 N/A HIS 230.A NE2 ASP 198.A OD1 no hydrogen 2.602 N/A CYS 231.A N SER 227.A O no hydrogen 2.949 N/A CYS 231.A SG PHE 226.A O no hydrogen 3.781 N/A CYS 231.A SG SER 227.A O no hydrogen 3.563 N/A CYS 231.A SG ASN 228.A OD1 no hydrogen 3.741 N/A ILE 234.A N HIS 230.A O no hydrogen 2.811 N/A MET 235.A N CYS 231.A O no hydrogen 3.313 N/A GLU 236.A N PHE 232.A O no hydrogen 3.082 N/A ARG 237.A N ASP 233.A O no hydrogen 2.836 N/A ARG 237.A NE ASP 206.A OD1 no hydrogen 2.907 N/A ARG 237.A NH2 ASP 206.A OD2 no hydrogen 2.903 N/A TYR 238.A N ILE 234.A O no hydrogen 3.015 N/A TYR 238.A N MET 235.A O no hydrogen 3.353 N/A TYR 238.A OH ASP 206.A OD1 no hydrogen 2.443 N/A GLN 239.A N MET 235.A O no hydrogen 2.827 N/A GLN 239.A NE2 ILE 459.A O no hydrogen 3.305 N/A TYR 242.A N TYR 238.A O no hydrogen 3.099 N/A TYR 242.A OH GLU 210.A OE1 no hydrogen 2.526 N/A ARG 243.A NE PRO 456.A O no hydrogen 2.814 N/A ARG 243.A NH1 PRO 217.A O no hydrogen 2.743 N/A ARG 243.A NH1 ALA 219.A O no hydrogen 3.056 N/A ARG 243.A NH2 PRO 456.A O no hydrogen 3.067 N/A CYS 244.A SG TYR 238.A O no hydrogen 3.647 N/A CYS 244.A SG TYR 242.A O no hydrogen 3.924 N/A PHE 245.A N ILE 221.A O no hydrogen 3.053 N/A ASN 246.A N GLN 250.A OE1 no hydrogen 2.790 N/A ILE 249.A N ASN 246.A OD1 no hydrogen 2.974 N/A GLN 250.A N ASN 246.A O no hydrogen 2.836 N/A THR 252.A N ASP 247.A O no hydrogen 3.114 N/A THR 252.A OG1 ASP 247.A O no hydrogen 3.427 N/A THR 252.A OG1 ASP 248.A O no hydrogen 2.542 N/A GLY 253.A N ILE 249.A O no hydrogen 3.331 N/A ALA 254.A N GLN 250.A O no hydrogen 3.153 N/A VAL 255.A N GLY 251.A O no hydrogen 2.965 N/A ILE 256.A N THR 252.A O no hydrogen 2.941 N/A ALA 257.A N GLY 253.A O no hydrogen 2.985 N/A ALA 258.A N ALA 254.A O no hydrogen 3.247 N/A GLY 259.A N VAL 255.A O no hydrogen 3.129 N/A PHE 260.A N ILE 256.A O no hydrogen 2.749 N/A LEU 261.A N ALA 257.A O no hydrogen 2.966 N/A ASN 262.A N ALA 258.A O no hydrogen 3.296 N/A ASN 262.A ND2 ASN 472.A O no hydrogen 3.142 N/A ASN 262.A ND2 LEU 485.A O no hydrogen 2.870 N/A ALA 263.A N GLY 259.A O no hydrogen 2.878 N/A ILE 264.A N PHE 260.A O no hydrogen 2.933 N/A LYS 265.A N LEU 261.A O no hydrogen 3.106 N/A LYS 265.A NZ ASN 262.A OD1 no hydrogen 3.183 N/A LEU 266.A N ASN 262.A O no hydrogen 3.149 N/A SER 267.A N ALA 263.A O no hydrogen 2.954 N/A SER 267.A OG ILE 264.A O no hydrogen 2.684 N/A SER 267.A OG VAL 269.A O no hydrogen 3.117 N/A GLY 268.A N LYS 265.A O no hydrogen 3.203 N/A GLN 273.A N SER 270.A O no hydrogen 2.935 N/A GLN 274.A N PRO 271.A O no hydrogen 3.258 N/A GLN 274.A NE2 VAL 269.A O no hydrogen 3.005 N/A ARG 275.A N THR 361.A OG1 no hydrogen 2.803 N/A ILE 276.A N THR 310.A O no hydrogen 2.776 N/A VAL 277.A N THR 362.A O no hydrogen 3.033 N/A VAL 278.A N TYR 312.A O no hydrogen 2.877 N/A PHE 279.A N LEU 364.A O no hydrogen 2.851 N/A GLY 280.A N VAL 314.A O no hydrogen 2.811 N/A VAL 286.A N GLY 282.A O no hydrogen 3.019 N/A GLY 287.A N SER 283.A O no hydrogen 2.839 N/A VAL 288.A N ALA 284.A O no hydrogen 2.897 N/A ALA 289.A N ALA 285.A O no hydrogen 3.021 N/A ASN 290.A N VAL 286.A O no hydrogen 2.958 N/A ASN 291.A N GLY 287.A O no hydrogen 2.889 N/A ILE 292.A N VAL 288.A O no hydrogen 3.017 N/A ALA 293.A N ALA 289.A O no hydrogen 3.040 N/A ALA 294.A N ASN 290.A O no hydrogen 2.855 N/A LEU 295.A N ASN 291.A O no hydrogen 3.002 N/A ALA 296.A N ILE 292.A O no hydrogen 2.976 N/A ALA 297.A N ALA 293.A O no hydrogen 2.892 N/A ARG 298.A N ALA 294.A O no hydrogen 2.953 N/A ARG 298.A NH1 GLU 506.A OE2 no hydrogen 3.142 N/A ARG 298.A NH2 GLU 469.A OE1 no hydrogen 2.742 N/A MET 299.A N LEU 295.A O no hydrogen 2.757 N/A TYR 300.A N ALA 296.A O no hydrogen 2.994 N/A LYS 301.A N ALA 297.A O no hydrogen 2.850 N/A ASP 306.A N PRO 303.A O no hydrogen 3.042 N/A LEU 307.A N PRO 303.A O no hydrogen 3.314 N/A VAL 308.A N VAL 304.A O no hydrogen 2.857 N/A LYS 309.A N GLN 305.A O no hydrogen 3.265 N/A THR 310.A N LEU 307.A O no hydrogen 2.932 N/A THR 310.A OG1 LEU 307.A O no hydrogen 2.699 N/A PHE 311.A N VAL 308.A O no hydrogen 3.172 N/A TYR 312.A N ILE 276.A O no hydrogen 2.686 N/A VAL 314.A N VAL 278.A O no hydrogen 2.823 N/A ASP 315.A N GLY 318.A O no hydrogen 3.065 N/A LYS 317.A N ASP 315.A OD1 no hydrogen 2.935 N/A GLY 318.A N ASP 315.A O no hydrogen 3.213 N/A GLY 318.A N ASP 315.A OD1 no hydrogen 3.123 N/A LEU 319.A N LEU 348.A O no hydrogen 3.018 N/A VAL 320.A N LEU 313.A O no hydrogen 2.764 N/A THR 321.A OG1 THR 323.A OG1 no hydrogen 3.298 N/A THR 321.A OG1 SER 345.A OG no hydrogen 2.953 N/A THR 322.A N ARG 337.A O no hydrogen 2.864 N/A THR 322.A OG1 ARG 337.A O no hydrogen 3.117 N/A THR 323.A N THR 321.A OG1 no hydrogen 3.209 N/A THR 323.A OG1 THR 321.A OG1 no hydrogen 3.298 N/A THR 323.A OG1 VAL 340.A O no hydrogen 2.517 N/A THR 323.A OG1 SER 345.A OG no hydrogen 3.103 N/A ARG 324.A NE ASP 326.A OD1 no hydrogen 2.889 N/A ARG 324.A NE ASP 326.A OD2 no hydrogen 3.322 N/A ARG 324.A NH1 ASP 315.A OD1 no hydrogen 2.792 N/A ARG 324.A NH1 ASP 315.A OD2 no hydrogen 3.401 N/A ARG 324.A NH1 LEU 319.A O no hydrogen 3.196 N/A ARG 324.A NH2 ASP 315.A OD1 no hydrogen 3.465 N/A ARG 324.A NH2 ASP 315.A OD2 no hydrogen 2.533 N/A ARG 324.A NH2 ASP 326.A OD2 no hydrogen 3.004 N/A HIS 331.A NE2 ALA 281.A O no hydrogen 2.698 N/A LYS 332.A N ALA 329.A O no hydrogen 3.082 N/A LYS 332.A NZ ASP 315.A OD2 no hydrogen 2.812 N/A LYS 333.A N ALA 330.A O no hydrogen 3.185 N/A ALA 336.A N LYS 333.A O no hydrogen 3.214 N/A ARG 337.A N VAL 320.A O no hydrogen 3.055 N/A ARG 337.A NE ASP 339.A OD1 no hydrogen 3.111 N/A ARG 337.A NH1 LYS 309.A O no hydrogen 2.875 N/A ARG 337.A NH1 PHE 311.A O no hydrogen 2.763 N/A ARG 337.A NH2 LYS 309.A O no hydrogen 3.404 N/A ARG 337.A NH2 ASP 339.A OD1 no hydrogen 3.460 N/A ARG 337.A NH2 ASP 339.A OD2 no hydrogen 3.019 N/A ASP 344.A N SER 341.A OG no hydrogen 2.894 N/A SER 345.A N SER 341.A O no hydrogen 2.788 N/A SER 345.A OG THR 321.A OG1 no hydrogen 2.953 N/A SER 345.A OG THR 323.A OG1 no hydrogen 3.103 N/A SER 345.A OG SER 341.A O no hydrogen 3.086 N/A ALA 346.A N ALA 342.A O no hydrogen 3.009 N/A LYS 347.A N ASP 344.A O no hydrogen 2.881 N/A LEU 348.A N SER 345.A O no hydrogen 2.908 N/A ARG 349.A N GLU 353.A OE2 no hydrogen 2.810 N/A ARG 349.A NH1 SER 345.A O no hydrogen 3.560 N/A THR 350.A N GLU 353.A OE2 no hydrogen 3.041 N/A ILE 354.A N THR 350.A O no hydrogen 3.003 N/A VAL 355.A N LEU 351.A O no hydrogen 2.775 N/A ARG 356.A N GLU 352.A O no hydrogen 2.993 N/A ARG 356.A NH1 GLU 352.A OE1 no hydrogen 3.270 N/A ARG 356.A NH2 GLU 352.A OE1 no hydrogen 2.682 N/A PHE 357.A N GLU 353.A O no hydrogen 2.945 N/A VAL 358.A N ILE 354.A O no hydrogen 2.725 N/A LYS 359.A N VAL 355.A O no hydrogen 2.946 N/A THR 361.A N ARG 275.A O no hydrogen 2.849 N/A THR 361.A OG1 GLN 274.A OE1 no hydrogen 2.649 N/A THR 361.A OG1 ARG 275.A O no hydrogen 3.287 N/A THR 362.A N ARG 275.A O no hydrogen 3.083 N/A THR 362.A OG1 GLN 274.A OE1 no hydrogen 2.676 N/A LEU 363.A N ILE 389.A O no hydrogen 2.801 N/A LEU 364.A N VAL 277.A O no hydrogen 2.762 N/A GLY 365.A N PHE 391.A O no hydrogen 2.733 N/A LEU 366.A N PHE 279.A O no hydrogen 2.888 N/A GLY 367.A N GLU 401.A OE2 no hydrogen 2.858 N/A GLY 368.A N SER 394.A OG no hydrogen 2.902 N/A ALA 372.A N GLY 370.A O no hydrogen 3.073 N/A PHE 373.A N GLU 401.A O no hydrogen 2.878 N/A GLU 376.A N GLU 376.A OE1 no hydrogen 2.848 N/A ILE 377.A N THR 374.A OG1 no hydrogen 3.179 N/A VAL 378.A N THR 374.A O no hydrogen 2.846 N/A LYS 379.A N GLU 375.A O no hydrogen 2.974 N/A LYS 379.A NZ GLU 375.A OE2 no hydrogen 2.460 N/A MET 380.A N GLU 376.A O no hydrogen 2.953 N/A VAL 381.A N ILE 377.A O no hydrogen 3.053 N/A MET 382.A N VAL 378.A O no hydrogen 3.050 N/A GLN 383.A N MET 380.A O no hydrogen 2.827 N/A ASN 384.A N VAL 381.A O no hydrogen 2.811 N/A ASN 384.A ND2 PRO 360.A O no hydrogen 3.088 N/A ARG 387.A N THR 385.A OG1 no hydrogen 3.232 N/A ARG 387.A NE ALA 414.A O no hydrogen 2.812 N/A ARG 387.A NH2 ALA 414.A O no hydrogen 3.534 N/A ILE 389.A N THR 361.A O no hydrogen 3.285 N/A ILE 390.A N ILE 416.A O no hydrogen 2.951 N/A PHE 391.A N LEU 363.A O no hydrogen 2.874 N/A LEU 393.A N GLY 365.A O no hydrogen 2.927 N/A SER 394.A N GLU 401.A OE1 no hydrogen 3.284 N/A SER 394.A OG GLU 401.A OE1 no hydrogen 3.413 N/A SER 394.A OG GLU 401.A OE2 no hydrogen 2.537 N/A LYS 399.A N PRO 396.A O no hydrogen 2.898 N/A GLU 401.A N GLU 401.A OE1 no hydrogen 2.744 N/A ASN 406.A N THR 403.A OG1 no hydrogen 3.019 N/A ALA 407.A N THR 403.A O no hydrogen 3.033 N/A TYR 408.A N PRO 404.A O no hydrogen 2.889 N/A LYS 409.A N GLU 405.A O no hydrogen 2.828 N/A TRP 410.A N ASN 406.A O no hydrogen 2.871 N/A THR 411.A N ALA 407.A O no hydrogen 3.258 N/A THR 411.A OG1 ALA 407.A O no hydrogen 2.641 N/A THR 411.A OG1 TYR 408.A O no hydrogen 3.276 N/A ASN 412.A N LYS 409.A O no hydrogen 2.792 N/A GLY 413.A N TYR 408.A O no hydrogen 2.769 N/A ALA 414.A N THR 411.A O no hydrogen 3.080 N/A ALA 415.A N THR 411.A OG1 no hydrogen 3.018 N/A ILE 416.A N PRO 388.A O no hydrogen 2.770 N/A SER 419.A N SER 436.A O no hydrogen 2.943 N/A SER 419.A OG SER 421.A O no hydrogen 3.042 N/A SER 421.A OG ASN 395.A OD1 no hydrogen 3.404 N/A THR 426.A N PHE 433.A O no hydrogen 2.605 N/A THR 427.A OG1 THR 432.A OG1 no hydrogen 3.054 N/A ILE 428.A N LYS 431.A O no hydrogen 2.659 N/A LYS 431.A N ILE 428.A O no hydrogen 2.964 N/A THR 432.A OG1 THR 427.A OG1 no hydrogen 3.054 N/A PHE 433.A N THR 426.A O no hydrogen 2.708 N/A SER 436.A N VAL 417.A O no hydrogen 3.093 N/A GLN 437.A NE2 GLY 420.A O no hydrogen 3.569 N/A GLY 438.A N SER 419.A O no hydrogen 2.809 N/A ASN 440.A ND2 ASP 247.A OD2 no hydrogen 2.784 N/A ASN 440.A ND2 THR 252.A OG1 no hydrogen 3.035 N/A LEU 441.A N ASN 439.A OD1 no hydrogen 3.016 N/A TYR 442.A N ASN 439.A O no hydrogen 3.186 N/A TYR 442.A OH PRO 487.A O no hydrogen 2.649 N/A VAL 443.A N ASN 440.A O no hydrogen 3.022 N/A PHE 444.A N ASN 440.A O no hydrogen 3.392 N/A VAL 447.A N VAL 443.A O no hydrogen 3.051 N/A GLY 448.A N PHE 444.A O no hydrogen 2.884 N/A LEU 449.A N PRO 445.A O no hydrogen 2.738 N/A GLY 450.A N GLY 446.A O no hydrogen 2.779 N/A CYS 451.A N VAL 447.A O no hydrogen 2.936 N/A CYS 451.A SG VAL 447.A O no hydrogen 3.241 N/A ALA 452.A N GLY 448.A O no hydrogen 2.870 N/A LEU 453.A N LEU 449.A O no hydrogen 3.003 N/A ALA 454.A N GLY 450.A O no hydrogen 2.740 N/A GLN 455.A N CYS 451.A O no hydrogen 2.911 N/A GLN 455.A NE2 ASN 218.A O no hydrogen 2.854 N/A GLN 455.A NE2 ALA 452.A O no hydrogen 3.035 N/A THR 457.A N ILE 512.A O no hydrogen 3.004 N/A THR 457.A OG1 HIS 458.A ND1 no hydrogen 3.006 N/A HIS 458.A ND1 THR 457.A OG1 no hydrogen 3.006 N/A GLU 462.A N GLU 462.A OE1 no hydrogen 2.758 N/A LEU 463.A N PRO 460.A O no hydrogen 3.041 N/A LEU 465.A N GLU 461.A O no hydrogen 2.964 N/A THR 466.A N GLU 462.A O no hydrogen 2.864 N/A THR 466.A OG1 GLU 462.A O no hydrogen 2.965 N/A THR 466.A OG1 GLU 506.A OE2 no hydrogen 2.768 N/A ALA 467.A N LEU 463.A O no hydrogen 3.026 N/A SER 468.A N LEU 464.A O no hydrogen 2.969 N/A SER 468.A OG ALA 254.A O no hydrogen 2.804 N/A GLU 469.A N LEU 465.A O no hydrogen 2.925 N/A SER 470.A N THR 466.A O no hydrogen 2.938 N/A SER 470.A OG ASN 498.A O no hydrogen 3.436 N/A SER 470.A OG ASP 502.A OD2 no hydrogen 2.722 N/A LEU 471.A N ALA 467.A O no hydrogen 2.878 N/A ASN 472.A N SER 468.A O no hydrogen 3.037 N/A ASN 472.A ND2 ALA 258.A O no hydrogen 2.983 N/A LEU 473.A N GLU 469.A O no hydrogen 2.899 N/A LEU 474.A N SER 470.A O no hydrogen 3.044 N/A LEU 474.A N LEU 471.A O no hydrogen 3.205 N/A THR 475.A N ASN 472.A O no hydrogen 3.212 N/A THR 475.A OG1 ASN 472.A O no hydrogen 3.359 N/A THR 475.A OG1 LEU 485.A O no hydrogen 3.187 N/A THR 476.A N ASP 479.A OD2 no hydrogen 3.099 N/A ASP 479.A N THR 476.A OG1 no hydrogen 2.904 N/A LEU 480.A N THR 476.A O no hydrogen 2.743 N/A ARG 481.A N GLU 477.A O no hydrogen 2.789 N/A GLU 482.A N GLY 478.A O no hydrogen 3.048 N/A GLY 483.A N LEU 480.A O no hydrogen 3.003 N/A ARG 484.A N ASP 479.A O no hydrogen 2.998 N/A ARG 484.A NH1 LYS 434.A O no hydrogen 2.918 N/A ARG 484.A NH2 PRO 435.A O no hydrogen 3.329 N/A LEU 485.A N SER 436.A OG no hydrogen 3.074 N/A TYR 486.A OH VAL 255.A O no hydrogen 2.792 N/A ASP 491.A N PRO 488.A O no hydrogen 3.023 N/A ASN 494.A ND2 ASP 491.A OD2 no hydrogen 3.564 N/A ILE 495.A N ASP 491.A O no hydrogen 2.968 N/A SER 496.A N ILE 492.A O no hydrogen 2.774 N/A SER 496.A OG GLY 160.A O no hydrogen 2.797 N/A SER 496.A OG ILE 492.A O no hydrogen 3.033 N/A ALA 497.A N HIS 493.A O no hydrogen 2.865 N/A ASN 498.A N ASN 494.A O no hydrogen 3.094 N/A ASN 498.A ND2 ASN 494.A O no hydrogen 2.923 N/A VAL 499.A N ILE 495.A O no hydrogen 2.894 N/A ALA 500.A N SER 496.A O no hydrogen 2.881 N/A THR 501.A N ALA 497.A O no hydrogen 2.949 N/A THR 501.A OG1 ALA 497.A O no hydrogen 2.620 N/A ASP 502.A N ASN 498.A O no hydrogen 3.086 N/A VAL 503.A N VAL 499.A O no hydrogen 2.845 N/A ILE 504.A N ALA 500.A O no hydrogen 2.771 N/A LEU 505.A N THR 501.A O no hydrogen 2.895 N/A GLU 506.A N ASP 502.A O no hydrogen 2.943 N/A ALA 507.A N VAL 503.A O no hydrogen 2.986 N/A GLN 508.A N ILE 504.A O no hydrogen 2.822 N/A GLN 508.A NE2 PRO 519.A O no hydrogen 3.210 N/A ARG 509.A N LEU 505.A O no hydrogen 2.897 N/A ARG 509.A NE GLU 506.A OE1 no hydrogen 2.828 N/A ARG 509.A NH1 GLU 506.A OE1 no hydrogen 3.201 N/A MET 510.A N GLU 506.A O no hydrogen 3.069 N/A LYS 511.A N GLN 508.A O no hydrogen 2.881 N/A ILE 512.A N ALA 507.A O no hydrogen 3.205 N/A ASN 514.A N ALA 454.A O no hydrogen 2.964 N/A ASN 515.A N ALA 454.A O no hydrogen 3.310 N/A ASN 515.A ND2 LEU 453.A O no hydrogen 2.842 N/A LYS 516.A NZ ASP 513.A O no hydrogen 2.900 N/A LYS 517.A N ASN 515.A OD1 no hydrogen 3.000 N/A ARG 520.A NH1 ASP 513.A OD2 no hydrogen 3.427 N/A THR 521.A OG1 GLU 524.A OE1 no hydrogen 2.680 N/A ARG 522.A NE ASP 502.A OD1 no hydrogen 2.737 N/A ARG 522.A NH1 ASN 498.A OD1 no hydrogen 3.464 N/A ARG 522.A NH2 ASN 498.A OD1 no hydrogen 2.886 N/A ARG 522.A NH2 ASP 502.A OD1 no hydrogen 3.439 N/A ARG 522.A NH2 ASP 502.A OD2 no hydrogen 2.879 N/A GLU 524.A N GLU 524.A OE1 no hydrogen 2.775 N/A LEU 525.A N THR 521.A O no hydrogen 3.060 N/A LEU 526.A N ARG 522.A O no hydrogen 2.809 N/A ALA 527.A N ASP 523.A O no hydrogen 3.165 N/A PHE 528.A N GLU 524.A O no hydrogen 3.037 N/A VAL 529.A N LEU 525.A O no hydrogen 2.831 N/A LYS 530.A N LEU 526.A O no hydrogen 3.099 N/A LYS 531.A N ALA 527.A O no hydrogen 3.314 N/A ALA 532.A N PHE 528.A O no hydrogen 3.150 N/A ALA 532.A N VAL 529.A O no hydrogen 3.138 N/A MET 533.A N LYS 530.A O no hydrogen 3.346 N/A TRP 534.A N GLY 162.A O no hydrogen 2.745 N/A VAL 537.A N LYS 535.A O no hydrogen 2.854 N/A TYR 538.A OH GLN 38.A OE1 no hydrogen 2.549 N/A SER 539.A OG VAL 537.A O no hydrogen 3.266 N/A